(2S)-1-[4-(phenylmethyl)sulfonylpiperazin-1-yl]-3-(4-phenylphenoxy)propan-2-ol

Systemtic Name: (2S)-1-[4-(phenylmethyl)sulfonylpiperazin-1-yl]-3-(4-phenylphenoxy)propan-2-ol Openeye Name: (2S)-1-(4-benzylsulfonylpiperazin-1-yl)-3-(4-phenylphenoxy)propan-2-ol CAS Name: (2S)-1-[4-(phenylmethyl)sulfonyl-1-piperazinyl]-3-(4-phenylphenoxy)-2-propanol IUPAC Name: (2S)-1-(4-benzylsulfonylpiperazin-1-yl)-3-(4-phenylphenoxy)propan-2-ol Traditional Name: (2S)-1-(4-benzylsulfonylpiperazino)-3-(4-phenylphenoxy)propan-2-ol Formula: C26H30N2O4S MolecularWeight: 466.5924

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(COC2=CC=C(C=C2)C3=CC=CC=C3)O)S(=O)(=O)CC4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C[C@@H](COC2=CC=C(C=C2)C3=CC=CC=C3)O)S(=O)(=O)CC4=CC=CC=C4

InChI

InChI=1S/C26H30N2O4S/c29-25(20-32-26-13-11-24(12-14-26)23-9-5-2-6-10-23)19-27-15-17-28(18-16-27)33(30,31)21-22-7-3-1-4-8-22/h1-14,25,29H,15-21H2/t25-/m0/s1